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Information card for entry 4032841
Preview
Coordinates | 4032841.cif |
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Original paper (by DOI) | HTML |
Formula | C19 H14 N2 O2 |
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Calculated formula | C19 H14 N2 O2 |
SMILES | n12c([O-])cccc1c([n+]1ccccc21)C(=O)c1ccc(cc1)C |
Title of publication | Cobalt/Copper-Cocatalyzed Synthesis of Imidazo[1,2-a:3,4-a']dipyridiniums from 2H-[1,2'-Bipyridin]-2-ones and 2-Bromoacetophenones. |
Authors of publication | Li, Ting; Fu, Chen; Ma, Qinge; Sang, Zhipei; Yang, Yuhan; Yang, Hao; Lv, Rongrong; Li, Bo |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2017 |
Journal volume | 82 |
Journal issue | 19 |
Pages of publication | 10263 - 10270 |
a | 4.5484 ± 0.0004 Å |
b | 12.7871 ± 0.0012 Å |
c | 13.9287 ± 0.0014 Å |
α | 115.468 ± 0.009° |
β | 91.873 ± 0.007° |
γ | 97.603 ± 0.007° |
Cell volume | 721.31 ± 0.13 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1193 |
Residual factor for significantly intense reflections | 0.0639 |
Weighted residual factors for significantly intense reflections | 0.1533 |
Weighted residual factors for all reflections included in the refinement | 0.1965 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.922 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4032841.html
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Users of the data should acknowledge the original authors of the
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